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1. TradeRepublicTableExport TradeRepublicTableExport Public

   ipynb notebook and py script with gui to export csv files out of Trade Republic statements which are distributed in .pdf format

   Jupyter Notebook

2. raw2xyN raw2xyN Public

   Quick and easy BRUKER .raw converter into .xy and .xyn files.

   Jupyter Notebook 1

3. DigitalSpaceGroupData DigitalSpaceGroupData Public

   A collection of python modules to extract data from the Bilbao database of crystallography. Ready-to-go .json and .csv files about data contained in the International Table of Crystallography are a…

4. macBatteryAllert macBatteryAllert Public

   Quick atuomator apple script to get the battery allert and show a message window to allert the user when battery falls below critical levels

   AppleScript

5. TopasAvogadroZmatrixConverter TopasAvogadroZmatrixConverter Public

   Script to convert Gaussian ZMatrix to Topas format ZMatrix. This way u can create rigid bodies in Avogadro, save it as Gaussian ZMatrix and then load it into Topas thanks to this script

   Jupyter Notebook

6. hkl_generator hkl_generator Public

   hkl_generator is a Python-based tool for generating and analyzing crystallographic reflection conditions (hkl indices) using space group symmetry rules. The tool leverages data from the Bilbao Crys…

   Jupyter Notebook